2-(2-nitrophenyl)-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]ethanamide

Systemtic Name: 2-(2-nitrophenyl)-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]ethanamide Openeye Name: 2-(2-nitrophenyl)-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]acetamide CAS Name: 2-(2-nitrophenyl)-N-[[2-(1-pyrrolidinyl)-4-pyridin-1-iumyl]methyl]acetamide IUPAC Name: 2-(2-nitrophenyl)-N-[(2-pyrrolidin-1-ylpyridin-1-ium-4-yl)methyl]acetamide Traditional Name: 2-(2-nitrophenyl)-N-[(2-pyrrolidinopyridin-1-ium-4-yl)methyl]acetamide Formula: C18H21N4O3+ MolecularWeight: 341.38434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=[NH+]C=CC(=C2)CNC(=O)CC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=[NH+]C=CC(=C2)CNC(=O)CC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O3/c23-18(12-15-5-1-2-6-16(15)22(24)25)20-13-14-7-8-19-17(11-14)21-9-3-4-10-21/h1-2,5-8,11H,3-4,9-10,12-13H2,(H,20,23)/p+1